5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(propylamino)benzenecarbonitrile

Systemtic Name: 5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(propylamino)benzenecarbonitrile Openeye Name: 5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(propylamino)benzonitrile CAS Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]-2-(propylamino)benzonitrile IUPAC Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]-2-(propylamino)benzonitrile Traditional Name: 5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(propylamino)benzonitrile Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)C(CNC(C)(C)C)O)C#N

Isomeric SMILES

CCCNC1=C(C=C(C=C1)C(CNC(C)(C)C)O)C#N

InChI

InChI=1S/C16H25N3O/c1-5-8-18-14-7-6-12(9-13(14)10-17)15(20)11-19-16(2,3)4/h6-7,9,15,18-20H,5,8,11H2,1-4H3